8-methyl-4-[4-(4-nitrophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole

SpectraBase Compound ID	IBCLm380Mlj
InChI	InChI=1S/C21H20N6O2/c1-14-2-7-18-17(12-14)19-20(24-18)21(23-13-22-19)26-10-8-25(9-11-26)15-3-5-16(6-4-15)27(28)29/h2-7,12-13,24H,8-11H2,1H3
InChIKey	MHLSUMGSALAECU-UHFFFAOYSA-N Google Search
Mol Weight	388.43 g/mol
Molecular Formula	C21H20N6O2
Exact Mass	388.164774 g/mol

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SpectraBase Spectrum ID	Ho85Z0HJThj
Name	8-methyl-4-[4-(4-nitrophenyl)-1-piperazinyl]-5H-pyrimido[5,4-b]indole
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H20N6O2/c1-14-2-7-18-17(12-14)19-20(24-18)21(23-13-22-19)26-10-8-25(9-11-26)15-3-5-16(6-4-15)27(28)29/h2-7,12-13,24H,8-11H2,1H3
InChIKey	MHLSUMGSALAECU-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_13447
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 102007; Labnumber: PRBS12-3-4397; VK_ID: VK-013452
Temperature	308 °C